M. Rapacioli

France

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Articles (11)

Year:

2023

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2023

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2023

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2023

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2023

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2022

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2022

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2022

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2022

Year:

2021

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2021

Collaborators (7)

Elisabetta Micelotta

University of Helsinki

FINLAND

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Cyril Falvo

Professor

University of Paris-Sud

FRANCE

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Alessandra Candian

Academic, Assistant Professor, null

University of Amsterdam

NETHERLANDS

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Nathalie Tarrat

FRANCE

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Aude Simon

FRANCE

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Annemieke Petrignani

University of Amsterdam

NETHERLANDS

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Emmanuel Dartois

Université Paris-Saclay

FRANCE

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M. Rapacioli

Research Interests

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Articles (11)

Emission spectra of fullerenes: Computational evidence for blackbody-like radiation due to structural diversity and electronic similarity

Erratum: Structures and stabilities of PAH clusters solvated by water aggregates: The case of the pyrene dimer [J. Chem. Phys. 158, 114308 (2023)]

Low-Energy Transformation Pathways between Naphthalene Isomers

Structures and stabilities of PAH clusters solvated by water aggregates: The case of the pyrene dimer

Dissipative friction dynamics within the density-functional based tight-binding scheme

Radiative relaxation in isolated large carbon clusters: Vibrational emission versus recurrent fluorescence

PDRs4All

Periodic DFTB for Supported Clusters: Implementation and Application on Benzene Dimers Deposited on Graphene

Coupling density functional based tight binding with class 1 force fields in a hybrid QM/MM scheme

IRMPD spectroscopy of a PAH cation using FELICE: The infrared spectrum and photodissociation of dibenzo[a,l]pyrene

Exploring energy landscapes at the DFTB quantum level using the threshold algorithm: the case of the anionic metal cluster Au$$_{20}^{-}$$

Collaborators (7)

Elisabetta Micelotta

Cyril Falvo

Alessandra Candian

Nathalie Tarrat

Aude Simon

Annemieke Petrignani

Emmanuel Dartois

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